1-pyrazolo[1,5-b]pyridazin-3-ylethanamine

C8H10N4 — CID 163321371

IUPAC1-pyrazolo[1,5-b]pyridazin-3-ylethanamine
SMILESCC(N)c1cnn2ncccc12
InChIInChI=1S/C8H10N4/c1-6(9)7-5-11-12-8(7)3-2-4-10-12/h2-6H,9H2,1H3
InChIKeyKDYLREDAWLNVND-UHFFFAOYSA-N
MW162.20 g/mol
LogP0.75
Rot. Bonds1

About 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine

1-pyrazolo[1,5-b]pyridazin-3-ylethanamine (PubChem CID 163321371) has the molecular formula C8H10N4 and a molecular weight of 162.20 g/mol. Its IUPAC name is 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine.

Molecular Properties

Compound Name1-pyrazolo[1,5-b]pyridazin-3-ylethanamine
PubChem CID163321371
Molecular FormulaC8H10N4
Molecular Weight162.20 g/mol
Exact Mass162.09
IUPAC Name1-pyrazolo[1,5-b]pyridazin-3-ylethanamine
SMILESCC(N)c1cnn2ncccc12
InChIInChI=1S/C8H10N4/c1-6(9)7-5-11-12-8(7)3-2-4-10-12/h2-6H,9H2,1H3
InChIKeyKDYLREDAWLNVND-UHFFFAOYSA-N
XLogP0.75
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.20
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine?
The IUPAC name of 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine (CID 163321371) is 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine.
What is the SMILES notation for 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine?
The canonical SMILES for 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine is CC(N)c1cnn2ncccc12.
What is the InChIKey of 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine?
The InChIKey is KDYLREDAWLNVND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4/c1-6(9)7-5-11-12-8(7)3-2-4-10-12/h2-6H,9H2,1H3.
What are the key properties of 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine?
1-pyrazolo[1,5-b]pyridazin-3-ylethanamine has a molecular weight of 162.20 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazolo[1,5-b]pyridazin-3-ylethanamine is sourced from PubChem (CID 163321371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).